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Ethene Dimerization on Zeolite-Hosted Ni Ions: Reversible Mobilization of the Active Site
[Image: see text] The active site in ethene oligomerization catalyzed by Ni-zeolites is proposed to be a mobile Ni(II) complex, based on density functional theory-based molecular dynamics (DFT-MD) simulations corroborated by continuous-flow experiments on Ni-SSZ-24 zeolite. The results of the simula...
| Autores principales: | , , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American
Chemical Society
2019
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6559053/ https://www.ncbi.nlm.nih.gov/pubmed/31205799 http://dx.doi.org/10.1021/acscatal.9b00721 |